Crystallography Open Database

Information card for entry 4114002

Preview

Coordinates	4114002.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	Tris[di-tert-butyl(methyl)silyl]stannyl
Formula	C27 H63 Si3 Sn
Calculated formula	C27 H63 Si3 Sn
SMILES	[Sn]([Si](C)(C(C)(C)C)C(C)(C)C)([Si](C)(C(C)(C)C)C(C)(C)C)[Si](C)(C(C)(C)C)C(C)(C)C
Title of publication	Tin-Centered Radical and Cation: Stable and Free
Authors of publication	Akira Sekiguchi; Tomohide Fukawa; Vladimir Ya. Lee; Masaaki Nakamoto
Journal of publication	Journal of the American Chemical Society
Year of publication	2003
Journal volume	125
Pages of publication	9250 - 9251
a	9.046 ± 0.0002 Å
b	31.573 ± 0.0008 Å
c	12.025 ± 0.0003 Å
α	90°
β	94.337 ± 0.002°
γ	90°
Cell volume	3424.62 ± 0.14 Å³
Cell temperature	120 K
Ambient diffraction temperature	120 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0359
Residual factor for significantly intense reflections	0.0315
Weighted residual factors for significantly intense reflections	0.0832
Weighted residual factors for all reflections included in the refinement	0.0861
Goodness-of-fit parameter for all reflections included in the refinement	1.057
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
178911 (current)	2016-03-22	cif/4/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/11/40.	4114002.cif
120077	2014-07-12	Adding DOIs to range 4/11 structures.	4114002.cif
67280	2012-09-20	cif/ Adding structures of 4114002 via cif-deposit CGI script.	4114002.cif